SCHEMBL21187455

SCHEMBL21187455

Cc1cccc(-n2cnc3cc(F)cc(F)c32)c1-c1ccc(F)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 2/20 0.42
▸ DPP4 P27487 2/20 0.36
▸ MAPK13 O15264 1/20 0.35
▸ MAPK12 P53778 1/20 0.35
▸ MAPK11 Q15759 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ CHRNA7 P36544 1/20 0.35
▸ P2RX7 Q99572 2/20 0.35
▸ BTK Q06187 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21187491 0.83 FFAR1 (0.34) HSD11B1CHRNA7BTK
SCHEMBL21187498 0.83 HSD11B1 (0.39) HSD11B1DPP4MAPK13MAPK12MAPK11
SCHEMBL21187456 0.82 MAPK14 (0.36) HSD11B1DPP4MAPK13MAPK12MAPK11
SCHEMBL21187500 0.82 HSD11B1 (0.43) HSD11B1MAPK13MAPK12MAPK11MAPK14
SCHEMBL21187447 0.80 FGFR1 (0.44) HSD11B1BTK
SCHEMBL21187448 0.80 FGFR1 (0.44) HSD11B1DPP4MAPK13MAPK12MAPK11
SCHEMBL21182369 0.78 HSD11B1 (0.39) HSD11B1DPP4P2RX7
SCHEMBL20698166 0.77 HSD11B1 (0.41) HSD11B1DPP4P2RX7
SCHEMBL20697945 0.77 HSD11B1 (0.39) HSD11B1DPP4P2RX7
SCHEMBL21187502 0.77 ALDH1A1 (0.38) BTK

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3740474-B1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2022-01-05 — — EP disclosed
US-20200339543-A1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2020-10-29 — — US disclosed
WO-2019141972-A1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2019-07-25 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200339543-A1 AGRICULTURAL CHEMICALS ABAT, BRDT, GABBR1 HSD11B1 930/4885DPP4 282/4885MAPK13 2672/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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